Cas no 538-64-7 (2-Butenedioic acid(2E)-, 1,4-bis(phenylmethyl) ester)

2-Butenedioic acid(2E)-, 1,4-bis(phenylmethyl) ester structure
538-64-7 structure
Product Name:2-Butenedioic acid(2E)-, 1,4-bis(phenylmethyl) ester
CAS No:538-64-7
MF:C18H16O4
MW:296.317245483398
CID:372959
PubChem ID:2829312
Update Time:2025-04-19

2-Butenedioic acid(2E)-, 1,4-bis(phenylmethyl) ester Chemical and Physical Properties

Names and Identifiers

    • 2-Butenedioic acid(2E)-, 1,4-bis(phenylmethyl) ester
    • 4-oxo-4-phenylmethoxybut-2-enoate
    • 4-oxidanylidene-4-phenylmethoxy-but-2-enoate
    • 4-oxo-4-phenylmethoxy-2-butenoate
    • Benzylfumarate
    • Dibenzyl fumarate
    • dibenzyl maleate
    • Dibenzylfumarat
    • Fumarsaeure-dibenzylester
    • K095ZNL0LQ
    • SR-01000196544
    • dibenzyl (E)-but-2-enedioate
    • SCHEMBL357565
    • 2-Butenedioic acid (2E)-, 1,4-bis(phenylmethyl) ester
    • UNII-K095ZNL0LQ
    • Fumaric acid, dibenzyl ester
    • dibenzyl (2E)-but-2-enedioate
    • 538-64-7
    • dibenzyl (2E)-2-butenedioate
    • F97110
    • Benzyl fumarate [MI]
    • SR-01000196544-1
    • Maleic acid, dibenzyl ester
    • Q27281774
    • CPZVJYPXOWWFSW-VAWYXSNFSA-N
    • NSC-7577
    • SCHEMBL337504
    • Benzyl fumarate
    • (2E)-2-Butenedioic acid 1,4-bis(phenylmethyl) ester
    • Inchi： 1S/C18H16O4/c19-17(21-13-15-7-3-1-4-8-15)11-12-18(20)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2/b12-11+
    • InChI Key： CPZVJYPXOWWFSW-VAWYXSNFSA-N
    • SMILES： O(C(/C=C/C(=O)OCC1C=CC=CC=1)=O)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 296.10500
  • Monoisotopic Mass: 296.105
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 8
  • Complexity: 341
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 52.6A^2
  • XLogP3: 3.2

Experimental Properties

  • Density: 1.1874 (rough estimate)
  • Melting Point: 58.5-59.5°
  • Boiling Point: bp5 210-211°
  • Flash Point: 209.1°C
  • Refractive Index: 1.5400 (estimate)
  • PSA: 52.60000
  • LogP: 3.02940

2-Butenedioic acid(2E)-, 1,4-bis(phenylmethyl) ester Customs Data

  • HS CODE：2917190090
  • Customs Data：

    China Customs Code:

    2917190090

    Overview:

    2917190090 Other acyclic polycarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Terephthalic acid please specify4-CBAvalue, Terephthalic acid please specifyP-TLacid value, Terephthalic acid please indicate color, Terephthalic acid please indicate moisture

    Summary:

    2917190090 acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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